2-[5-(4-imidazol-1-ylphenoxy)pentyl]isoindole-1,3-dione

Systemtic Name: 2-[5-(4-imidazol-1-ylphenoxy)pentyl]isoindole-1,3-dione Openeye Name: 2-[5-(4-imidazol-1-ylphenoxy)pentyl]isoindoline-1,3-dione CAS Name: 2-[5-[4-(1-imidazolyl)phenoxy]pentyl]isoindole-1,3-dione IUPAC Name: 2-[5-(4-imidazol-1-ylphenoxy)pentyl]isoindole-1,3-dione Traditional Name: 2-[5-(4-imidazol-1-ylphenoxy)pentyl]isoindoline-1,3-quinone Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCOC3=CC=C(C=C3)N4C=CN=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCOC3=CC=C(C=C3)N4C=CN=C4

InChI

InChI=1S/C22H21N3O3/c26-21-19-6-2-3-7-20(19)22(27)25(21)13-4-1-5-15-28-18-10-8-17(9-11-18)24-14-12-23-16-24/h2-3,6-12,14,16H,1,4-5,13,15H2